| CAS Number | 6919-91-1 |
| Catalog Number | AG01CC3A(AGN-PC-0TV0U5) |
| Chemical Name | 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxododecyl)oxy]-,chloride, (R)- |
| IUPAC Name | [(2R)-3-carboxy-2-dodecanoyloxypropyl]-trimethylazanium;chloride |
| InChI | InChI=1S/C19H37NO4.ClH/c1-5-6-7-8-9-10-11-12-13-14-19(23)24-17(15-18(21)22)16-20(2,3)4;/h17H,5-16H2,1-4H3;1H/t17-;/m1./s1 |
| InChI Key | PDBBUDRTWRVCFN-UNTBIKODSA-N |
| MDL Number | MFCD00274131 |
| Molecular Formula | C19H38ClNO4 |
| Molecular Weight | 379.9623 |
| SMILES | OC(CC(C[N+](C)(C)C)OC(CCCCCCCCCCC)=O)=O.[Cl-] |
| Synonyms | LAUROYL-L-CARNITINE CHLORIDE,
6919-91-1,
C19H38NO4.Cl,
7301AH,
MFCD00274131,
AKOS032953976,
B6346,
( inverted exclamation markA)-Lauroylcarnitine chloride,
(2R)?-3-?Carboxy-?N,?N,?N-?trimethyl-?2-?[(1-?oxododecyl)?oxy]?-1-propanaminium chloride (1:1)?,
7023-03-2,
14919-37-0,
|
| Complexity | 350 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 379.249g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 379.966g/mol |
| Monoisotopic Mass | 379.249g/mol |
| Rotatable Bond Count | 16 |
| Topological Polar Surface Area | 63.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number